BRN 2914267

2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]-2-(4-methylphenyl)acetic acid

CAS: 23189-45-9

Molecular Formula	`C18H16I3NO4`
Molecular Weight	691.0 g/mol
LogP	4.9
Topological Polar Surface Area	66.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	690.8214
Heavy Atoms	26
Complexity	513.0

Chemical Identifiers

CAS Number	23189-45-9
SMILES	`CC1=CC=C(C=C1)C(C(=O)O)OC2=C(C=C(C(=C2I)N(C)C(=O)C)I)I`
InChIKey	`YYZJNFDAJSUZJV-UHFFFAOYSA-N`

📖 Product Overview

BRN 2914267 (CAS: 23189-45-9) is a chemical compound with molecular formula C18H16I3NO4 and molecular weight 691.0 g/mol. Its IUPAC systematic name is 2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]-2-(4-methylphenyl)acetic acid. LogP 4.9 Topological Polar Surface Area 66.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 5 Exact Mass 690.8214 Heavy Atoms 26 Complexity 513.0 InChI Key: YYZJNFDAJSUZJV-UHFFFAOYSA-N. SMILES: CC1=CC=C(C=C1)C(C(=O)O)OC2=C(C=C(C(=C2I)N(C)C(=O)C)I)I.

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